Geometry & MOs

Info

ID:	390895
PubChem CID:	135001465
Reduced:	N2O3H20C22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	250.09938
ΔH_f, kcal/mol:	8.92
Dipole, Da:	8.64
IP(EA), eV:	-9.68(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,13-dimethyl-10-oxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,4,6,9(16),11,13-hexaen-8-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations